Home Sulfos 1-(Isopropylsulfonyl)-2-nitrobenzene

1-(Isopropylsulfonyl)-2-nitrobenzene

CAS No.:
70415-86-0
Catalog Number:
AG00IC26
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$36
- +
250mg
95%
In Stock USA
United States
$69
- +
1g
95%
In Stock USA
United States
$137
- +
5g
95%
In Stock USA
United States
$410
- +
Product Description
Catalog Number:
AG00IC26
Chemical Name:
1-(Isopropylsulfonyl)-2-nitrobenzene
CAS Number:
70415-86-0
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
MDL Number:
MFCD13689001
IUPAC Name:
1-nitro-2-propan-2-ylsulfonylbenzene
InChI:
InChI=1S/C9H11NO4S/c1-7(2)15(13,14)9-6-4-3-5-8(9)10(11)12/h3-7H,1-2H3
InChI Key:
GBFWDLQEEMHXME-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1S(=O)(=O)C(C)C
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.041g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.25g/mol
Monoisotopic Mass:
229.041g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties